2-(5-decyl-4,5-dihydro-1H-imidazol-2-yl)ethanol

C15H30N2O — CID 18799084

IUPAC2-(5-decyl-4,5-dihydro-1H-imidazol-2-yl)ethanol
SMILESCCCCCCCCCCC1CN=C(CCO)N1
InChIInChI=1S/C15H30N2O/c1-2-3-4-5-6-7-8-9-10-14-13-16-15(17-14)11-12-18/h14,18H,2-13H2,1H3,(H,16,17)
InChIKeyYDMNLECZQJNFMB-UHFFFAOYSA-N
MW254.42 g/mol
LogP3.27
Rot. Bonds11

About 2-(5-decyl-4,5-dihydro-1H-imidazol-2-yl)ethanol

2-(5-decyl-4,5-dihydro-1H-imidazol-2-yl)ethanol (PubChem CID 18799084) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 2-(5-decyl-4,5-dihydro-1H-imidazol-2-yl)ethanol.

Molecular Properties

Compound Name2-(5-decyl-4,5-dihydro-1H-imidazol-2-yl)ethanol
PubChem CID18799084
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name2-(5-decyl-4,5-dihydro-1H-imidazol-2-yl)ethanol
SMILESCCCCCCCCCCC1CN=C(CCO)N1
InChIInChI=1S/C15H30N2O/c1-2-3-4-5-6-7-8-9-10-14-13-16-15(17-14)11-12-18/h14,18H,2-13H2,1H3,(H,16,17)
InChIKeyYDMNLECZQJNFMB-UHFFFAOYSA-N
XLogP3.27
TPSA44.62 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(5-decyl-4,5-dihydro-1H-imidazol-2-yl)ethanol?
The IUPAC name of 2-(5-decyl-4,5-dihydro-1H-imidazol-2-yl)ethanol (CID 18799084) is 2-(5-decyl-4,5-dihydro-1H-imidazol-2-yl)ethanol.
What is the SMILES notation for 2-(5-decyl-4,5-dihydro-1H-imidazol-2-yl)ethanol?
The canonical SMILES for 2-(5-decyl-4,5-dihydro-1H-imidazol-2-yl)ethanol is CCCCCCCCCCC1CN=C(CCO)N1.
What is the InChIKey of 2-(5-decyl-4,5-dihydro-1H-imidazol-2-yl)ethanol?
The InChIKey is YDMNLECZQJNFMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-2-3-4-5-6-7-8-9-10-14-13-16-15(17-14)11-12-18/h14,18H,2-13H2,1H3,(H,16,17).
What are the key properties of 2-(5-decyl-4,5-dihydro-1H-imidazol-2-yl)ethanol?
2-(5-decyl-4,5-dihydro-1H-imidazol-2-yl)ethanol has a molecular weight of 254.42 g/mol, XLogP of 3.27, 11 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-decyl-4,5-dihydro-1H-imidazol-2-yl)ethanol is sourced from PubChem (CID 18799084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).